5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride
TL;DR: 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride (CAS 37483-69-5) is a chemical compound with molecular formula C10H13Cl2NO and molecular weight 233.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)azanium chloride
Also Known As: 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride, 2,3,4,5-Tetrahydro-8-chloro-1-benzoxepin-5-amine hydrochloride, 1-BENZOXEPIN-5-AMINE, 2,3,4,5-TETRAHYDRO-8-CHLORO-, HYDROCHLORIDE, (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)azanium chloride
| Molecular Formula | C10H13Cl2NO |
|---|---|
| Molecular Weight | 233.04 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.03741 |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 37483-69-5 |
|---|---|
| SMILES | C1CC(C2=C(C=C(C=C2)Cl)OC1)[NH3+].[Cl-] |
| InChIKey | ZRAQEMHFRRTQPF-UHFFFAOYSA-N |
Product Overview
5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride (CAS 37483-69-5), with molecular formula C10H13Cl2NO and molecular weight 233.04 g/mol. IUPAC: (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)azanium chloride.
Chemical Property Profile of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride
Property Insights of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride
The XLogP value of -1.2 indicates that 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.9 Ų, 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride?
The CAS number of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride is 37483-69-5.
What is the molecular formula of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride?
The molecular formula of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride is C10H13Cl2NO.
What is the molecular weight of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride?
The molecular weight of 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride is 233.04 g/mol.
Where can I buy 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride?
You can request a quote for 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.